2-[3-(1,3-benzodioxol-5-ylmethyl)-5-oxidanylidene-1-phenyl-2-sulfanylidene-imidazolidin-4-yl]-N-(1H-indol-6-yl)ethanamide

Systemtic Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-5-oxidanylidene-1-phenyl-2-sulfanylidene-imidazolidin-4-yl]-N-(1H-indol-6-yl)ethanamide Openeye Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-5-oxo-1-phenyl-2-thioxo-imidazolidin-4-yl]-N-(1H-indol-6-yl)acetamide CAS Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-5-oxo-1-phenyl-2-sulfanylidene-4-imidazolidinyl]-N-(1H-indol-6-yl)acetamide IUPAC Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl]-N-(1H-indol-6-yl)acetamide Traditional Name: N-(1H-indol-6-yl)-2-(5-keto-1-phenyl-3-piperonyl-2-thioxo-imidazolidin-4-yl)acetamide Formula: C27H22N4O4S MolecularWeight: 498.55298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(C(=O)N(C3=S)C4=CC=CC=C4)CC(=O)NC5=CC6=C(C=C5)C=CN6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(C(=O)N(C3=S)C4=CC=CC=C4)CC(=O)NC5=CC6=C(C=C5)C=CN6

InChI

InChI=1S/C27H22N4O4S/c32-25(29-19-8-7-18-10-11-28-21(18)13-19)14-22-26(33)31(20-4-2-1-3-5-20)27(36)30(22)15-17-6-9-23-24(12-17)35-16-34-23/h1-13,22,28H,14-16H2,(H,29,32)